C1C(=O)NC2=CC=CC=C2C(=N1)C3=CC=CC=C3
CAS: 2898-08-0
Nombre: 5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
SMILES: C1C(=O)NC2=CC=CC=C2C(=N1)C3=CC=CC=C3

Molecular Processing

Molecular formula
C15H12N2O
Molecular weight
236.27
Exact mass
236.095
XLogP
2.48
TPSA
41.46
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.067
Molar refractivity
72.02

Supplementary Information

InChIKey: IVUAAOBNUNMJQC-UHFFFAOYSA-N
Sinónimos
2898-08-01,3-Dihydro-5-phenyl-2H-1,4-benzodiazepin-2-one2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-5-phenyl-Ro-05-29214JHQ7M3460EINECS 220-781-3NSC-656624DTXSID30183178RefChem:883676DTXCID40105669220-781-31,3-Dihydro-5-phenyl-1,4-benzodiazepin-2-one5-Phenyl-1,3-dihydrobenzo[e][1,4]diazepin-2-one5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-2-one5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one5-Phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-oneMFCD002777795-Phenyl-1,3-dihydro-benzo[e][1,4]diazepin-2-oneCHEMBL134585-PHENYL-1H-BENZO[E][1,4]DIAZEPIN-2(3H)-ONERo-052921DeschlorodemethyldiazepamNSC656624Maybridge1_006686Oprea1_710885MLS001182241UNII-4JHQ7M34602,3-Dihydro-2-oxo-5-phenyl-1H-1,4-benzodiazepine2,3-Dihydro-5-phenyl-1H-1,4-benzodiazepin-2-oneSCHEMBL1365706
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